| Properties | Image |
|---|
| MNX_ID | MNXM1029425 |
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| reference | slm:000721814 |
| formula | C57H107NO8P |
| global charge | -1 |
| mol weight | 965.456 |
| InChIKey | GAHBIUNPOFOKGO-YRHJIQTDSA-M |
| InChI | InChI=1S/C57H108NO8P/c1-4-7-10-13-16-19-22-25-28-30-33-36-39-42-45-48-56(59)58-50-52-64-67(61,62)65-54-55(53-63-51-47-44-41-38-35-32-27-24-21-18-15-12-9-6-3)66-57(60)49-46-43-40-37-34-31-29-26-23-20-17-14-11-8-5-2/h16,19,25,28,33,36,55H,4-15,17-18,20-24,26-27,29-32,34-35,37-54H2,1-3H3,(H,58,59)(H,61,62)/p-1/b19-16-,28-25-,36-33-/t55-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\CCCCC(=O)NCCOP(=O)([O-])OC[C@@H](COCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C57H108NO8P/c1-4-7-10-13-16-19-22-25-28-30-33-36-39-42-45-48-56(59)58-50-52-64-67(61,62)65-54-55(53-63-51-47-44-41-38-35-32-27-24-21-18-15-12-9-6-3)66-57(60)49-46-43-40-37-34-31-29-26-23-20-17-14-11-8-5-2/h16,19,25,28,33,36,55H,4-15,17-18,20-24,26-27,29-32,34-35,37-54H2,1-3H3,(H,58,59)(H,61,62)/b19-16-,28-25-,36-33-/t55-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:30]/[CH:33]=[CH:36]\[CH2:39][CH2:42][CH2:45][CH2:48][C:56](=[N:58][CH2:50][CH2:52][O:64][P:67]([OH:61])(=[O:62])[O:65][CH2:54][C@@H:55]([CH2:53][O:63][CH2:51][CH2:47][CH2:44][CH2:41][CH2:38][CH2:35][CH2:32][CH2:27][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[O:66][C:57]([CH2:49][CH2:46][CH2:43][CH2:40][CH2:37][CH2:34][CH2:31][CH2:29][CH2:26][CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:60])[OH:59] |
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